BDBM50064125 (S)-3-Cyclohexyl-2-[(S)-5-(2,4-difluoro-phenyl)-2-(phosphonomethyl-amino)-pent-4-ynoylamino]-propionic acid::CHEMBL39828

SMILES: OC(=O)[C@H](CC1CCCCC1)NC(=O)[C@H](CC#Cc1ccc(F)cc1F)NCP(O)(O)=O

InChI Key: InChIKey=RUFIIIBMKLELDY-OALUTQOASA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50064125   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Neprilysin (Homo sapiens (Human))	BDBM50064125 ((S)-3-Cyclohexyl-2-[(S)-5-(2,4-difluoro-phenyl)-2-...) Show SMILES OC(=O)[C@H](CC1CCCCC1)NC(=O)[C@H](CC#Cc1ccc(F)cc1F)NCP(O)(O)=O Show InChI InChI=1S/C21H27F2N2O6P/c22-16-10-9-15(17(23)12-16)7-4-8-18(24-13-32(29,30)31)20(26)25-19(21(27)28)11-14-5-2-1-3-6-14/h9-10,12,14,18-19,24H,1-3,5-6,8,11,13H2,(H,25,26)(H,27,28)(H2,29,30,31)/t18-,19-/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.07E+3	n/a	n/a	n/a	n/a	n/a	n/a
Novartis Pharmaceuticals Corporation Curated by ChEMBL					Assay Description Inhibitory activity against neutral endopeptidase (NEP).				J Med Chem 41: 1513-23 (1998) Article DOI: 10.1021/jm970787c BindingDB Entry DOI: 10.7270/Q2PV6M1M
					More data for this Ligand-Target Pair
Endothelin-converting enzyme 1 (ECE1) (Homo sapiens (Human))	BDBM50064125 ((S)-3-Cyclohexyl-2-[(S)-5-(2,4-difluoro-phenyl)-2-...) Show SMILES OC(=O)[C@H](CC1CCCCC1)NC(=O)[C@H](CC#Cc1ccc(F)cc1F)NCP(O)(O)=O Show InChI InChI=1S/C21H27F2N2O6P/c22-16-10-9-15(17(23)12-16)7-4-8-18(24-13-32(29,30)31)20(26)25-19(21(27)28)11-14-5-2-1-3-6-14/h9-10,12,14,18-19,24H,1-3,5-6,8,11,13H2,(H,25,26)(H,27,28)(H2,29,30,31)/t18-,19-/m0/s1	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	14	n/a	n/a	n/a	n/a	n/a	n/a
Novartis Pharmaceuticals Corporation Curated by ChEMBL					Assay Description Inhibitory activity was assessed on CHO cells expressing recombinant human Endothelin-converting enzyme 1 (ECE-1).				J Med Chem 41: 1513-23 (1998) Article DOI: 10.1021/jm970787c BindingDB Entry DOI: 10.7270/Q2PV6M1M
					More data for this Ligand-Target Pair